SCHEMBL27601067

SCHEMBL27601067

CCOC(=O)C(C)(C)Nc1ccc(N2CCOCC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.53
RAB9A P51151 3/20 0.53
NPC1 O15118 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
POLB P06746 1/20 0.51
LMNA P02545 2/20 0.49
GAA P10253 2/20 0.48
ALDH1A1 P00352 2/20 0.48
TP53 P04637 1/20 0.48
PKM P14618 1/20 0.48
MAPK1 P28482 1/20 0.48
MTOR P42345 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30872785 0.83 SMN1; SMN2 (0.43) MAPTSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL6646832 0.81 MAPT (0.56) MAPTRAB9ANPC1SMN1; SMN2POLB
SCHEMBL12205820 0.77 MAPT (0.52) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL16933596 0.77 LMNA (0.47) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL28750028 0.75 ALDH1A1 (0.55) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL28750029 0.75 ALDH1A1 (0.55) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL16841790 0.75 POLB (0.49) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL13996572 0.75 POLB (0.50) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL4485170 0.75 ABCB11 (0.56) MAPTSMN1; SMN2MEN1KMT2APOLB
SCHEMBL2986775 0.74 MAPT (0.56) MAPTRAB9ANPC1SMN1; SMN2POLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1500081-A Thiohydantonins and use thereof for treating diabetes ʵ���Ҹ���Ү��˾ 2004-05-26 CN disclosed